Skip to main content
. 2017 Jan 1;73(Pt 1):31–34. doi: 10.1107/S2056989016019563

Table 2. Experimental details.

Crystal data
Chemical formula [Cu(ClO4)(C8H20N4)]ClO4
M r 434.72
Crystal system, space group Monoclinic, P21/n
Temperature (K) 173
a, b, c (Å) 8.9387 (2), 15.0607 (4), 11.9235 (3)
β (°) 92.949 (1)
V3) 1603.05 (7)
Z 4
Radiation type Mo Kα
μ (mm−1) 1.74
Crystal size (mm) 0.23 × 0.21 × 0.18
 
Data collection
Diffractometer Bruker SMART APEXII CCD
Absorption correction Multi-scan (SADABS; Sheldrick, 2014)
T min, T max 0.667, 0.747
No. of measured, independent and observed [I > 2σ(I)] reflections 43306, 7519, 6655
R int 0.021
(sin θ/λ)max−1) 0.830
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.025, 0.068, 1.02
No. of reflections 7519
No. of parameters 221
No. of restraints 6
H-atom treatment H atoms treated by a mixture of independent and constrained refinement
Δρmax, Δρmin (e Å−3) 0.60, −0.44

Computer programs: APEX2 and SAINT-Plus (Bruker, 2013), SHELXT (Sheldrick, 2008), SHELXL2014 (Sheldrick, 2015) and SHELXLE (Hübschle et al., 2011).